sodium 2-(1-azanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl)ethanoic acid

Systemtic Name: sodium 2-(1-azanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl)ethanoic acid Openeye Name: sodium 2-(1-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl)acetic acid CAS Name: sodium 2-(1-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl)acetic acid IUPAC Name: sodium 2-(1-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl)acetic acid Traditional Name: sodium 2-(1-amino-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl)acetic acid Formula: C12H14N2NaO3+ MolecularWeight: 257.24093

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C(=O)C1CC(=O)O)N.[Na+]

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1CC(=O)O)N.[Na+]

InChI

InChI=1S/C12H14N2O3.Na/c13-14-10-4-2-1-3-8(10)5-6-9(12(14)17)7-11(15)16;/h1-4,9H,5-7,13H2,(H,15,16);/q;+1